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Potassium Cation → 2-{[6-(3-Pentanoyl-1-benzofuran-2-yl)-2-naphthyl]oxy}-3-phenylpropanoic acid

HRID 1235484
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반응식

HRID 1235484 반응식
[C:1]([CH2:2][CH2:3][CH2:4][CH3:5])(=[O:6])[c:7]1[c:8](-[c:16]2[cH:17][c:18]3[cH:19][cH:20][c:21]([O:26][CH:27]([C:28](=[O:29])[O:30][CH2:31][CH3:32])[CH2:33][c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[cH:22][c:23]3[cH:24][cH:25]2)[o:9][c:10]2[c:11]1[cH:12][cH:13][cH:14][cH:15]2.[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[K+:41].[OH-:40].[OH2:47]>>[C:1]([CH2:2][CH2:3][CH2:4][CH3:5])(=[O:6])[c:7]1[c:8](-[c:16]2[cH:17][c:18]3[cH:19][cH:20][c:21]([O:26][CH:27]([C:28](=[O:29])[OH:30])[CH2:33][c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[cH:22][c:23]3[cH:24][cH:25]2)[o:9][c:10]2[c:11]1[cH:12][cH:13][cH:14][cH:15]2
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 813Potassium CationHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 12082833Ethyl 2-{[6-(3-pentanoyl-1-benzofuran-2-yl)-2-naphthyl]oxy}-3-phenylpropanoate

생성물 1

HCID 102067802-{[6-(3-Pentanoyl-1-benzofuran-2-yl)-2-naphthyl]oxy}-3-phenylpropanoic acid

출처 및 근거

ORD 기록
ord-39c72f8c8f744a7f8e2a9d575c7cfb8b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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